Information card for entry 2221944

Structure parameters

• Chemical name: 2-Chloro-<i>N</i>-(2,5-dichlorophenyl)acetamide
• Formula: C8 H6 Cl3 N O
• Calculated formula: C8 H6 Cl3 N O
• SMILES: Clc1c(NC(=O)CCl)cc(Cl)cc1
• Title of publication: 2-Chloro-<i>N</i>-(2,5-dichlorophenyl)acetamide
• Authors of publication: Gowda, B. Thimme; Foro, Sabine; Terao, Hiromitsu; Fuess, Hartmut
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 6
• Pages of publication: o1445
• a: 7.492 ± 0.002 Å
• b: 8.496 ± 0.002 Å
• c: 8.988 ± 0.002 Å
• α: 69.68 ± 0.02°
• β: 67.54 ± 0.02°
• γ: 66.67 ± 0.02°
• Cell volume: 472.4 ± 0.2 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.066
• Residual factor for significantly intense reflections: 0.0396
• Weighted residual factors for significantly intense reflections: 0.0883
• Weighted residual factors for all reflections included in the refinement: 0.0978
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes